⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL15069874 | 1.00 | — | — | |
| SCHEMBL4818972 | 0.88 | TSHR (0.31) | — | |
| SCHEMBL19325120 | 0.88 | TSHR (0.31) | — | |
| SCHEMBL14286687 | 0.88 | TSHR (0.31) | — | |
| SCHEMBL20332237 | 0.88 | TSHR (0.31) | — | |
| SCHEMBL19325220 | 0.88 | — | — | |
| SCHEMBL383731 | 0.87 | TSHR (0.32) | — | |
| SCHEMBL2204919 | 0.86 | MEN1 (0.33) | — | |
| SCHEMBL26023297 | 0.86 | — | — | |
| SCHEMBL20127845 | 0.86 | MEN1 (0.33) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9125922-B2 | Phosphate esters of gyrase and topoisomerase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2015-09-08 | — | — | US | disclosed |
| US-9125922-B2 | Phosphate esters of gyrase and topoisomerase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2015-09-08 | — | — | US | disclosed |
| US-20130157979-A1 | PHOSPHATE ESTERS OF GYRASE AND TOPOISOMERASE INHIBITORS | SPERO THERAPEUTICS, INC. | 2013-06-20 | — | — | US | disclosed |
| US-20130157979-A1 | PHOSPHATE ESTERS OF GYRASE AND TOPOISOMERASE INHIBITORS | SPERO THERAPEUTICS, INC. | 2013-06-20 | — | — | US | disclosed |